Crystallography Open Database
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| 1556002 | CIF | C29 H28 N2 O3 | P 1 21/c 1 | 12.7136; 19.6481; 10.0368 90; 104.806; 90 | 2423.9 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556003 | CIF | C29 H28 N2 O3 | P 1 21/c 1 | 8.088; 29.039; 10.3957 90; 98.253; 90 | 2416.3 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556004 | CIF | C28 H26 N2 O3 | P -1 | 9.715; 11.622; 13.28 64.317; 86.248; 74.246 | 1298.2 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556005 | CIF | C26 H30 N2 O3 | P 1 21/c 1 | 11.5919; 14.5845; 13.8674 90; 97.872; 90 | 2322.4 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556006 | CIF | C34 H36 Cl2 N2 O5 | P 1 21/c 1 | 10.3241; 23.365; 13.7004 90; 99.642; 90 | 3258.2 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556007 | CIF | C33 H34 N2 O5 | P 1 21/c 1 | 13.9135; 11.8443; 18.4125 90; 108.518; 90 | 2877.2 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556008 | CIF | C29.5 H29 Cl N2 O3 S | P 32 2 1 | 18.4813; 18.4813; 16.4257 90; 90; 120 | 4858.7 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556009 | CIF | C26 H30 N2 O3 | P 1 21/n 1 | 9.5688; 10.3956; 23.8948 90; 96.847; 90 | 2359.9 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556010 | CIF | C24 H24 N2 O2 | P 1 21/c 1 | 10.9969; 11.8906; 15.8497 90; 106.796; 90 | 1984.1 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556011 | CIF | C33 H34 N2 O5 | P 1 21/c 1 | 16.2583; 8.9359; 19.545 90; 95.231; 90 | 2827.7 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556012 | CIF | C26 H30 N2 O3 | P 1 21/c 1 | 15.2433; 10.1136; 14.943 90; 94.937; 90 | 2295.1 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556013 | CIF | C29 H28 N2 O3 | P 1 21/c 1 | 7.8226; 30.639; 10.1141 90; 98.682; 90 | 2396.3 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556014 | CIF | C29 H28 N2 O3 S | P 1 21/c 1 | 8.6571; 29.45; 10.2183 90; 98.7924; 90 | 2574.56 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556015 | CIF | C26 H30 N2 O3 | C 1 2/c 1 | 17.3068; 12.0144; 22.5999 90; 96.044; 90 | 4673.1 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556016 | CIF | C29 H28 N2 O3 | C 1 2 1 | 22.49; 5.1816; 20.19 90; 90.78; 90 | 2352.6 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556017 | CIF | C29 H28 N2 O3 S | P 1 21/n 1 | 19.7344; 12.7882; 20.279 90; 97.031; 90 | 5079.3 | Halli, Juliette; Bolte, Michael; Bats, Jan; Manolikakes, Georg Modular Two-Step Approach for the Stereodivergent Synthesis of 1,3-Diamines with Three Continuous Stereocenters. Organic letters, 2017, 19, 674-677 |
| 1556018 | CIF | C23 H17 Cl O3 | C 1 2 1 | 20.5553; 9.5675; 22.2196 90; 115.687; 90 | 3937.9 | Infante, Rebeca; Martin-Alvarez, Jose M; Andrés, Celia; Nieto, Javier Dimethylzinc-Mediated Addition of Phenylacetylene to α-Diketones Catalyzed by Chiral Perhydro-1,3-benzoxazines. Organic letters, 2017, 19, 1516-1519 |
| 1556019 | CIF | C16 H11 F N2 O | P 21 21 21 | 8.4334; 9.1934; 16.9142 90; 90; 90 | 1311.4 | Jin, Yushu; Chen, Ming; Ge, Shaozhong; Hartwig, John F. Palladium-Catalyzed, Enantioselective α-Arylation of α-Fluorooxindoles. Organic letters, 2017, 19, 1390-1393 |
| 1556020 | CIF | C15 H12 N2 O | P 1 21/n 1 | 16.4017; 7.1335; 20.0858 90; 95.665; 90 | 2338.6 | Yin, Kun; Zhang, Ronghua Transition-Metal-Free Direct C-H Arylation of Quinoxalin-2(1H)-ones with Diaryliodonium Salts at Room Temperature. Organic letters, 2017, 19, 1530-1533 |
| 1556021 | CIF | C16 H14 N2 O | P n a 21 | 9.9288; 26.7988; 4.7384 90; 90; 90 | 1260.79 | Yin, Kun; Zhang, Ronghua Transition-Metal-Free Direct C-H Arylation of Quinoxalin-2(1H)-ones with Diaryliodonium Salts at Room Temperature. Organic letters, 2017, 19, 1530-1533 |
| 1556022 | CIF | C17 H13 N O | P 1 21/c 1 | 4.0198; 13.908; 23.21 90; 94.2; 90 | 1294.1 | Wu, Xia; Geng, Xiao; Zhao, Peng; Zhang, Jingjing; Gong, Xingxing; Wu, Yan-Dong; Wu, An-Xin I<sub>2</sub>-Promoted Povarov-Type Reaction Using 1,4-Dithane-2,5-diol as an Ethylene Surrogate: Formal [4 + 2] Synthesis of Quinolines. Organic letters, 2017, 19, 1550-1553 |
| 1556023 | CIF | C11 H13 N S2 | P 1 21 1 | 9.9321; 22.705; 19.824 90; 98.538; 90 | 4420.9 | Wu, Xia; Geng, Xiao; Zhao, Peng; Zhang, Jingjing; Gong, Xingxing; Wu, Yan-Dong; Wu, An-Xin I<sub>2</sub>-Promoted Povarov-Type Reaction Using 1,4-Dithane-2,5-diol as an Ethylene Surrogate: Formal [4 + 2] Synthesis of Quinolines. Organic letters, 2017, 19, 1550-1553 |
| 1556024 | CIF | C43 H30 N2 O2 | P -1 | 10.4789; 12.074; 12.5011 92.552; 94.697; 98.319 | 1557.2 | Feng, Yadong; Tian, Nian; Li, Yudong; Jia, Chunqi; Li, Xuening; Wang, Lianhui; Cui, Xiuling Construction of Fused Polyheterocycles through Sequential [4 + 2] and [3 + 2] Cycloadditions. Organic letters, 2017, 19, 1658-1661 |
| 1556025 | CIF | C42 H28 N2 O2 | P b c a | 18.5446; 17.7946; 18.9442 90; 90; 90 | 6251.5 | Feng, Yadong; Tian, Nian; Li, Yudong; Jia, Chunqi; Li, Xuening; Wang, Lianhui; Cui, Xiuling Construction of Fused Polyheterocycles through Sequential [4 + 2] and [3 + 2] Cycloadditions. Organic letters, 2017, 19, 1658-1661 |
| 1556026 | CIF | C47 H36 Cl2 N4 O S Zn | P -1 | 11.0032; 12.6313; 14.724 98.868; 96.16; 102.84 | 1950 | Gholami, Hadi; Zhang, Jun; Anyika, Mercy; Borhan, Babak Absolute Stereochemical Determination of Asymmetric Sulfoxides via Central to Axial Induction of Chirality. Organic letters, 2017, 19, 1722-1725 |
| 1556027 | CIF | C51 H37 N5 O S Zn | P 1 | 10.6689; 10.8762; 18.2817 83.457; 84.152; 77.519 | 2051.2 | Gholami, Hadi; Zhang, Jun; Anyika, Mercy; Borhan, Babak Absolute Stereochemical Determination of Asymmetric Sulfoxides via Central to Axial Induction of Chirality. Organic letters, 2017, 19, 1722-1725 |
| 1556028 | CIF | C32 H27 Br O2 | P 1 21 1 | 9.624; 31.096; 13.229 90; 91.141; 90 | 3958 | Perveen, Saima; Zhao, Zhifei; Zhang, Guoxiang; Liu, Jian; Anwar, Muhammad; Fang, Xinqiang Enantioselective Synthesis of 1,2-Dihydronaphthalenes via Oxidative N-Heterocyclic Carbene Catalysis. Organic letters, 2017, 19, 2470-2473 |
| 1556029 | CIF | C94 H64 O2 | P -1 | 9.9734; 11.3386; 15.3837 79.9686; 85.4756; 79.5603 | 1682.69 | Vadehra, Geeta S.; Jiang, Xing; Dotson, Jordan J.; Chu, Gong M.; Garcia-Garibay, Miguel A High-Yielding and Divergent Paradigm for the Synthesis of D<sub>2h</sub>-Symmetric Octakis-Substituted Pentiptycenequinones. Organic letters, 2017, 19, 1838-1841 |
| 1556030 | CIF | C24 H26 N2 O6 | P 1 21 1 | 11.0167; 8.4713; 13.145 90; 112.969; 90 | 1129.5 | Ran, Guang-Yao; Gong, Ming; Yue, Jing-Fei; Yang, Xing-Xing; Zhou, Su-Lan; Du, Wei; Chen, Ying-Chun Asymmetric Cascade Assembly of 1,2-Diaza-1,3-dienes and α,β-Unsaturated Aldehydes via Dienamine Activation. Organic letters, 2017, 19, 1874-1877 |
| 1556031 | CIF | C14 H9 N O3 S | P 1 21/c 1 | 12.0277; 13.0209; 8.1447 90; 106.121; 90 | 1225.4 | Jeran, Marko; Cotman, Andrej Emanuel; Stephan, Michel; Mohar, Barbara Stereopure Functionalized Benzosultams via Ruthenium(II)-Catalyzed Dynamic Kinetic Resolution-Asymmetric Transfer Hydrogenation. Organic letters, 2017, 19, 2042-2045 |
| 1556032 | CIF | C14 H13 N O3 S | P 21 21 21 | 7.4865; 10.7242; 32.3467 90; 90; 90 | 2597.01 | Jeran, Marko; Cotman, Andrej Emanuel; Stephan, Michel; Mohar, Barbara Stereopure Functionalized Benzosultams via Ruthenium(II)-Catalyzed Dynamic Kinetic Resolution-Asymmetric Transfer Hydrogenation. Organic letters, 2017, 19, 2042-2045 |
| 1556033 | CIF | C14 H12 N O3 S | P 21 21 21 | 9.4952; 13.78766; 23.3234 90; 90; 90 | 3053.42 | Jeran, Marko; Cotman, Andrej Emanuel; Stephan, Michel; Mohar, Barbara Stereopure Functionalized Benzosultams via Ruthenium(II)-Catalyzed Dynamic Kinetic Resolution-Asymmetric Transfer Hydrogenation. Organic letters, 2017, 19, 2042-2045 |
| 1556034 | CIF | C24 H24 N2 O3 Se | P 1 21/c 1 | 9.4838; 10.5004; 21.1264 90; 90.868; 90 | 2103.6 | Foley, Christopher; Shaw, Arthur; Hulme, Christopher Oxidative Deaminations and Deisatinylations of Ugi-Azide and Ugi-3CR Products: A Two-Step MCR-Oxidation Protocol toward Functionalized α-Ketoamides and α-Ketotetrazoles. Organic letters, 2017, 19, 2238-2241 |
| 1556035 | CIF | C14 H16 N4 O | P 1 21/m 1 | 7.7378; 6.7075; 12.6395 90; 102.323; 90 | 640.89 | Foley, Christopher; Shaw, Arthur; Hulme, Christopher Oxidative Deaminations and Deisatinylations of Ugi-Azide and Ugi-3CR Products: A Two-Step MCR-Oxidation Protocol toward Functionalized α-Ketoamides and α-Ketotetrazoles. Organic letters, 2017, 19, 2238-2241 |
| 1556036 | CIF | C28 H44 Cl2 N8 Ni O2 | I m -3 m | 17.0714; 17.0714; 17.0714 90; 90; 90 | 4975.2 | Zhang, Xingjie; Xia, Aiyou; Chen, Haoyi; Liu, Yuanhong General and Mild Nickel-Catalyzed Cyanation of Aryl/Heteroaryl Chlorides with Zn(CN)<sub>2</sub>: Key Roles of DMAP. Organic letters, 2017, 19, 2118-2121 |
| 1556037 | CIF | C23 H18 O2 | P 1 21 1 | 6.0965; 7.8294; 17.9271 90; 96.951; 90 | 849.41 | Zhang, Jingfang; Tang, Yuhai; Wei, Wen; Wu, Yong; Li, Yang; Zhang, Junjie; Zheng, Yuansuo; Xu, Silong Organocatalytic Cloke-Wilson Rearrangement: DABCO-Catalyzed Ring Expansion of Cyclopropyl Ketones to 2,3-Dihydrofurans. Organic letters, 2017, 19, 3043-3046 |
| 1556038 | CIF | C26 H34 O4 Si | P 21 21 21 | 9.47; 15.075; 17.824 90; 90; 90 | 2544.6 | Han, Man-Yi; Xie, Xiaoyu; Zhou, Di; Li, Pinhua; Wang, Lei Organocatalyzed Direct Aldol Reaction of Silyl Glyoxylates for the Synthesis of α-Hydroxysilanes. Organic letters, 2017, 19, 2282-2285 |
| 1556039 | CIF | C16 H13 Br F3 N O3 | P 21 21 21 | 5.8132; 8.851; 31.166 90; 90; 90 | 1603.6 | Wang, Pei; Li, Hong-Feng; Zhao, Jia-Zhen; Du, Zhi-Hong; Da, Chao-Shan Organocatalytic Enantioselective Cross-Aldol Reaction of o-Hydroxyarylketones and Trifluoromethyl Ketones. Organic letters, 2017, 19, 2634-2637 |
| 1556040 | CIF | C22 H26 O4 S | P b c a | 5.5413; 15.8031; 45.3572 90; 90; 90 | 3971.92 | Zhurakovskyi, Oleksandr; Ellis, Sam R.; Thompson, Amber L.; Robertson, Jeremy Access to a Guanacastepene and Cortistatin-Related Skeleton via Ethynyl Lactone Ireland-Claisen Rearrangement and Transannular (4 + 3)-Cycloaddition of an Azatrimethylenemethane Diyl. Organic letters, 2017, 19, 2174-2177 |
| 1556041 | CIF | C19 H37 Br Cu N3 P2 | I 41 c d | 31.5316; 31.5316; 18.8701 90; 90; 90 | 18761.4 | Mastalir, Matthias; Pittenauer, Ernst; Stöger, Berthold; Allmaier, Günter; Kirchner, Karl Three Different Reactions, One Catalyst: A Cu(I) PNP Pincer Complex as Catalyst for C-C and C-N Cross-Couplings. Organic letters, 2017, 19, 2178-2181 |
| 1556042 | CIF | C27 H22 O S | P 21 21 21 | 5.3756; 8.23448; 44.3104 90; 90; 90 | 1961.41 | Wang, Zhaobin; Sun, Jianwei Enantioselective [4 + 2] Cycloaddition of o-Quinone Methides and Vinyl Sulfides: Indirect Access to Generally Substituted Chiral Chromanes. Organic letters, 2017, 19, 2334-2337 |
| 1556043 | CIF | C11 H10 F7 N3 O2 | P 1 21/c 1 | 16.1302; 7.5328; 12.1195 90; 90.161; 90 | 1472.6 | Wang, Rui; Guan, Wei; Han, Zheng-Bo; Liang, Fushun; Suga, Takeo; Bi, Xihe; Nishide, Hiroyuki Ambient-Light-Promoted Three-Component Annulation: Synthesis of Perfluoroalkylated Pyrimidines. Organic letters, 2017, 19, 2358-2361 |
| 1556044 | CIF | C25 H31 N O7 Si | P -1 | 9.5604; 11.3393; 12.5938 64.094; 79.058; 86.136 | 1205.56 | Parsons, Philip J.; Jones, Daniel R.; Walsh, Lee J.; Allen, Lewis A. T.; Onwubiko, Ada; Preece, Lewis; Board, Johnathan; White, Andrew J. P. An Approach to the Core of Lactonamycin. Organic letters, 2017, 19, 2533-2535 |
| 1556045 | CIF | C19 H20 O3 | C 1 2 1 | 17.9303; 6.8625; 13.4226 90; 99.456; 90 | 1629.16 | Iwamoto, Hiroaki; Akiyama, Sota; Hayama, Keiichi; Ito, Hajime Copper(I)-Catalyzed Stereo- and Chemoselective Borylative Radical Cyclization of Alkyl Halides Bearing an Alkene Moiety. Organic letters, 2017, 19, 2614-2617 |
| 1556046 | CIF | C12 H6 O S2 | P b c a | 5.541; 15.387; 22.574 90; 90; 90 | 1925 | Mitsudo, Koichi; Kurimoto, Yuji; Mandai, Hiroki; Suga, Seiji Synthesis of 3-Benzo[b]thienyl 3-Thienyl Ether via an Addition-Elimination Reaction and Its Transformation to an Oxygen-Fused Dithiophene Skeleton: Synthesis and Properties of Benzodithienofuran and Its π-Extended Derivatives. Organic letters, 2017, 19, 2821-2824 |
| 1556047 | CIF | C19 H26 Cl N2 O Rh | P b c a | 8.0471; 16.3426; 29.6614 90; 90; 90 | 3900.8 | Long, Zhen; Yang, Yudong; You, Jingsong Rh(III)-Catalyzed [4 + 1]-Annulation of Azoxy Compounds with Alkynes: A Regioselective Approach to 2H-Indazoles. Organic letters, 2017, 19, 2781-2784 |
| 1556048 | CIF | C22 H24 Cl N2 O Rh | P 1 21/n 1 | 7.58618; 16.9757; 15.6843 90; 93.0656; 90 | 2016.94 | Long, Zhen; Yang, Yudong; You, Jingsong Rh(III)-Catalyzed [4 + 1]-Annulation of Azoxy Compounds with Alkynes: A Regioselective Approach to 2H-Indazoles. Organic letters, 2017, 19, 2781-2784 |
| 1556049 | CIF | C116 H112 Cl2 N10 Ni | P -1 | 12.6554; 19.7134; 21.0374 72.334; 80.809; 82.734 | 4919.7 | Yin, Bangshao; Kim, Taeyeon; Zhou, Mingbo; Huang, Weiming; Kim, Dongho; Song, Jianxin Porphyrin-Azobenzene-Bodipy Triads: Syntheses, Structures, and Photophysical Properties. Organic letters, 2017, 19, 2654-2657 |
| 1556050 | CIF | C27 H23 N O3 S | P 21 21 21 | 11.4379; 12.8956; 15.0848 90; 90; 90 | 2225 | Wang, Zhen; Xu, Huacheng; Su, Qin; Hu, Ping; Shao, Pan-Lin; He, Yun; Lu, Yixin Enantioselective Synthesis of Tetrahydropyridines/Piperidines via Stepwise [4 + 2]/[2 + 2] Cyclizations. Organic letters, 2017, 19, 3111-3114 |
| 1556051 | CIF | C33 H26 Cl N O4 S | P 21 21 21 | 8.9355; 14.869; 20.8047 90; 90; 90 | 2764.2 | Wang, Zhen; Xu, Huacheng; Su, Qin; Hu, Ping; Shao, Pan-Lin; He, Yun; Lu, Yixin Enantioselective Synthesis of Tetrahydropyridines/Piperidines via Stepwise [4 + 2]/[2 + 2] Cyclizations. Organic letters, 2017, 19, 3111-3114 |
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